SCHEMBL14734694

SCHEMBL14734694

COc1ccc(-c2ccc3c(c2)COC3=O)c(OC2(C(=O)O)CC2)c1OC

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.52
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
PRF1 P14222 1/20 0.44
IMPDH2 P12268 1/20 0.44
CYP3A4 P08684 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14737363 0.92 PDE4D (0.52) PDE4DKDM4ELMNAPDE4APDE4B
SCHEMBL2591590 0.88 PDE4D (0.56) PDE4DKDM4ELMNAPDE4APDE4B
SCHEMBL14750841 0.88 PDE4D (0.55) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2591415 0.87 PDE4D (0.58) PDE4DKDM4ELMNAPDE4APDE4B
SCHEMBL14736841 0.87 PDE4D (0.58) PDE4DKDM4ELMNAPDE4APDE4B
SCHEMBL2590947 0.86 PDE4D (0.56) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2592433 0.86 PDE4D (0.57) PDE4DPDE4APDE4BPDE4C
SCHEMBL2594814 0.85 PDE4D (0.58) PDE4DPDE4APDE4BPDE4C
SCHEMBL2584267 0.85 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL2585094 0.85 PDE4D (0.57) PDE4DPRF1PDE4APDE4BPDE4C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563770-A1 BIARYL PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2013-03-06 EP disclosed